NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 H 4.5143 8.4293 116.2128 55.1409 30.3648 173.2504 2 C 4.1861 7.7024 114.1113 56.8858 30.0218 172.1508 3 D 4.5827 8.3895 118.3563 55.0672 40.1654 175.5114 4 L 4.0801 8.0512 120.1056 57.1966 42.2204 175.7084 5 P 4.6079 0.0000 0.0000 62.3558 32.2544 175.4857 6 C 4.2365 8.5105 114.0207 58.0462 30.5722 174.9637 7 G 3.9214 8.2519 107.3554 45.4352 0.0000 172.9157 8 V 4.2313 7.1994 119.2423 61.1828 32.1576 174.4930 9 Y 4.7819 8.1828 123.8485 56.5639 42.0271 174.6345 10 D 3.9037 8.0753 119.9980 51.5345 44.1340 174.5024 11 P 4.0652 0.0000 0.0000 64.9708 31.1315 178.0788 12 A 3.9596 8.7304 120.4371 55.1533 17.9695 179.7110 13 Q 3.7561 7.9777 116.3508 59.0260 28.6948 178.6602 14 A 4.0496 7.8163 121.2017 55.2238 18.4165 179.4329 15 R 3.8124 8.2000 117.4050 59.6607 30.1856 178.5955 16 I 3.7264 8.0158 118.6031 64.0524 37.8986 177.7660 17 E 3.9812 8.0877 119.4685 59.3582 29.3276 179.1787 18 A 4.0231 8.3786 121.1060 55.0429 18.2995 179.5309 19 E 3.9618 8.6631 118.0281 59.6069 29.4651 179.7254 20 S 4.1170 8.1173 114.3893 61.1829 63.0301 176.6704 21 V 3.5417 7.9818 121.9872 65.8077 31.2248 177.9843 22 K 4.1364 8.1449 119.0900 59.4552 31.9339 178.6065 23 A 4.1592 8.3141 121.3921 55.0950 18.2865 179.8185 24 V 3.5363 8.2220 117.2127 66.1917 31.6165 178.1146 25 Q 4.0305 8.2442 117.8887 59.2280 28.6965 178.9731 26 E 4.0031 8.5145 119.6176 59.4102 29.5027 179.5425 27 K 4.0951 8.4549 118.7699 59.8295 31.9214 179.2451 28 M 4.3621 8.0509 117.6005 57.8054 31.9250 178.0075 29 A 4.3678 7.8940 119.5966 53.3362 18.7829 177.9835 30 G 3.8895 7.8447 104.3559 45.0820 0.0000 173.4056 31 N 4.5409 7.7660 118.7726 52.6467 39.6100 172.9657 32 D 4.7119 8.5320 124.2451 53.1380 40.1147 176.7224 33 D 4.3856 8.5891 121.0336 54.5271 42.0522 175.0021 34 P 4.2629 0.0000 0.0000 65.9661 31.3572 178.0255 35 H 4.1315 8.3504 116.4932 59.2608 29.7612 176.8464 36 F 4.0506 8.5468 122.3457 61.4985 39.2349 176.9846 37 Q 3.9477 8.4945 117.8673 59.2774 28.4558 179.1929 38 T 3.8052 8.0767 116.7411 66.6516 68.4401 176.9877 39 R 3.7607 7.9496 119.8352 59.1619 30.0640 178.9259 40 A 3.7119 7.7699 120.7794 55.3348 18.2559 179.8718 41 T 3.7370 7.7528 114.1647 66.6169 68.5435 176.9650 42 V 3.5215 7.7639 120.1347 66.2203 31.4619 178.2218 43 I 3.8634 7.8815 119.5939 64.1514 36.9077 178.1788 44 K 3.8146 8.4161 120.9592 59.5534 31.9603 178.2786 45 E 3.9001 8.1264 119.4045 59.4184 29.5469 178.9103 46 Q 3.9701 7.8822 117.5099 59.1499 28.8051 179.0017 47 R 3.9594 8.2926 119.0836 59.0434 30.0352 178.9883 48 A 3.9960 8.2268 120.8690 55.0358 18.3760 179.2912 49 E 3.8747 8.2576 117.9049 59.3543 29.6702 179.0220 50 L 3.9223 8.0092 118.8580 57.7393 41.6631 179.3059 51 A 4.0568 8.1810 120.6972 55.1171 18.2072 179.8201 52 K 3.9013 8.2345 117.0262 59.7346 32.0420 178.8594 53 H 4.0912 8.2437 118.4351 59.8078 29.7763 176.9549 54 H 4.2252 8.2708 117.8750 58.8217 28.5394 178.0230 55 V 3.6262 8.0305 120.0761 66.0049 31.3531 177.8594 56 S 4.2755 8.3403 113.1394 61.6898 62.1412 176.4075 57 V 3.6991 8.1255 120.9684 65.8591 31.1713 177.8114 58 L 3.9995 8.1312 118.8900 57.6809 41.3009 179.3790 59 W 4.7319 8.2976 127.0379 60.6406 30.7991 177.6720 60 S 4.0847 8.4442 112.8655 60.2877 62.9761 175.0985 61 D 4.7364 8.2699 120.8599 55.5452 41.9804 177.3040 62 Y 3.3775 7.5053 118.6092 59.8946 39.0960 175.6119 63 F 4.1763 7.8533 117.9181 57.1883 39.6317 174.9237 64 K 4.6569 7.9296 122.1377 53.0420 36.2012 175.3194 65 P 4.4190 0.0000 0.0000 65.8962 31.1033 177.1659 66 P 4.1898 0.0000 0.0000 65.7993 31.0741 178.4002 67 H 4.3902 8.0165 115.4658 58.8550 28.3008 177.8324 68 F 4.4481 7.5557 119.0695 60.1829 38.5414 177.3437 69 E 4.0421 8.3044 118.9131 59.1834 29.5676 178.4781 70 K 4.0478 7.9668 118.5767 57.8941 33.6286 176.3918 71 Y 4.9111 8.2642 116.9358 54.0920 37.6995 174.2354 72 P 4.5645 0.0000 0.0000 64.1968 31.8310 178.1074 73 E 4.2897 8.1653 116.2154 57.1501 30.5074 178.1415 74 L 3.9796 8.3267 122.8044 58.4200 42.0894 178.1388 75 H 4.2447 8.2061 115.8109 59.1843 28.7503 177.3705 76 Q 3.8762 8.0543 120.6166 58.8328 28.7979 177.7897 77 L 3.8710 7.8886 121.5504 58.0795 42.1204 179.1267 78 V 3.3916 7.7401 118.2350 65.9010 31.4156 177.4190 79 N 3.9564 7.7641 116.6581 56.7655 38.6584 176.5355 80 D 4.0755 8.2233 120.5856 57.3932 40.7722 178.9960 81 T 3.4649 7.5630 116.4337 66.4733 68.4159 176.7634 82 L 3.9412 7.8176 120.9318 57.7370 41.6258 179.7790 83 K 3.8886 8.0211 118.2038 59.3144 31.9495 179.2922 84 A 4.0425 8.0628 121.4571 55.3023 18.2460 179.3982 85 M 4.0359 8.2076 116.8315 58.7036 32.4075 178.5420 86 S 4.0855 8.2990 115.4063 61.6492 62.7796 176.6119 87 A 4.0277 7.9556 122.1258 54.9484 18.4782 179.2543 88 A 4.1823 8.1005 120.8435 54.5215 18.1877 179.7243 89 K 3.9297 8.0691 116.5887 59.7576 32.3396 179.0508 90 G 3.8298 7.6611 101.8511 44.8568 0.0000 173.1904 91 S 4.7392 7.2116 114.2868 56.4361 65.4938 173.7768 92 K 4.2308 8.5080 123.2221 56.7018 32.6441 176.3250 93 D 4.5732 8.2911 121.1353 52.8034 41.3062 175.1986 94 P 5.0235 0.0000 0.0000 64.6301 31.2097 178.2788 95 A 3.9986 8.5461 120.5507 55.2040 18.0022 179.7269 96 T 3.9656 8.2721 109.0016 64.8846 68.9110 177.2143 97 G 3.6100 8.1796 108.1739 47.5635 0.0000 175.3206 98 Q 3.9815 8.4223 122.1473 58.6836 29.0602 178.0772 99 K 3.8387 8.3524 120.7359 59.4119 32.1583 178.5708 100 A 4.1847 8.0470 120.9632 55.2951 18.2404 179.5148 101 L 3.9576 8.1288 117.4644 58.1676 41.5490 179.5740 102 D 4.3101 8.4622 119.2011 57.4344 40.6765 178.4577 103 Y 4.1857 7.9567 117.2834 61.2438 37.9012 178.6080 104 I 3.7843 8.2212 120.7005 64.3818 37.1237 178.3674 105 A 4.2179 8.3888 121.8106 55.1010 18.1916 179.7811 106 Q 3.9817 7.8580 116.9750 59.1981 28.7919 178.9018 107 I 3.7713 7.8715 120.9199 64.3172 37.0787 177.8843 108 D 4.3476 8.6450 119.3541 57.2486 41.0536 178.1773 109 K 4.0710 8.3605 120.1079 59.7080 32.2285 178.7566 110 I 3.4643 7.6218 119.4201 64.1936 36.8443 177.8102 111 F 3.9355 8.8378 121.8255 61.5511 38.8667 177.4623 112 W 4.2416 8.2694 116.6653 59.4905 29.0806 178.1175 113 E 4.2580 8.4324 119.2750 59.6752 28.7519 179.3368 114 T 4.5250 7.7023 109.4267 63.5494 68.9615 176.1113 115 K 4.1315 7.4412 120.2199 57.8246 32.2565 177.9850 116 K 4.4877 7.8529 117.6043 57.3432 33.6485 175.9511 117 A 4.1630 7.7120 126.0971 52.6928 18.9942 175.6513 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 H 8.43 4.51 0.00 3.23 3.28 0.00 5.48 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 C 7.70 4.19 0.00 3.12 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 D 8.39 4.58 0.00 2.88 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 L 8.05 4.08 0.00 1.60 1.75 0.91 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 5 P 0.00 4.61 0.00 2.28 2.09 0.00 3.81 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00 6 C 8.51 4.24 0.00 3.00 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 G 8.25 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 V 7.20 4.23 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.96 0.00 0.00 9 Y 8.18 4.78 0.00 2.82 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 D 8.08 3.90 0.00 2.63 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 P 0.00 4.07 0.00 2.24 1.89 0.00 2.96 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.04 0.00 12 A 8.73 3.96 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 Q 7.98 3.76 0.00 1.81 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.74 0.00 0.00 0.00 0.00 0.00 2.21 2.32 0.00 14 A 7.82 4.05 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 R 8.20 3.81 0.00 1.88 2.06 0.00 3.23 0.00 0.00 3.12 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.65 0.00 16 I 8.02 3.73 1.86 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.19 1.01 0.00 0.00 17 E 8.09 3.98 0.00 2.13 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.55 0.00 18 A 8.38 4.02 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 E 8.66 3.96 0.00 2.18 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.51 0.00 20 S 8.12 4.12 0.00 4.07 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 V 7.98 3.54 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 1.00 0.00 0.00 22 K 8.14 4.14 0.00 1.89 1.80 0.00 1.75 0.00 0.00 1.66 0.00 0.00 3.13 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.45 1.59 7.81 23 A 8.31 4.16 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 V 8.22 3.54 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.95 0.00 0.00 25 Q 8.24 4.03 0.00 2.34 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.58 0.00 0.00 0.00 0.00 0.00 2.39 2.55 0.00 26 E 8.51 4.00 0.00 2.19 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.52 0.00 27 K 8.45 4.10 0.00 2.11 2.24 0.00 1.78 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.75 1.79 7.81 28 M 8.05 4.36 0.00 2.05 2.31 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.90 2.52 0.00 29 A 7.89 4.37 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 G 7.84 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 N 7.77 4.54 0.00 2.25 2.24 0.00 0.00 7.08 8.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 D 8.53 4.71 0.00 2.85 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 D 8.59 4.39 0.00 2.86 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 P 0.00 4.26 0.00 2.24 2.12 0.00 3.70 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.18 0.00 35 H 8.35 4.13 0.00 3.26 3.60 0.00 5.87 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 F 8.55 4.05 0.00 3.12 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 Q 8.49 3.95 0.00 2.28 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.59 0.00 0.00 0.00 0.00 0.00 2.68 2.61 0.00 38 T 8.08 3.81 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 39 R 7.95 3.76 0.00 1.68 1.81 0.00 3.04 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.58 0.00 40 A 7.77 3.71 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 T 7.75 3.74 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 42 V 7.76 3.52 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.91 0.00 0.00 43 I 7.88 3.86 1.86 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.47 0.87 0.00 0.00 44 K 8.42 3.81 0.00 1.79 1.97 0.00 1.76 0.00 0.00 1.56 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.44 7.81 45 E 8.13 3.90 0.00 2.26 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.38 0.00 46 Q 7.88 3.97 0.00 2.28 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.58 0.00 0.00 0.00 0.00 0.00 2.36 2.52 0.00 47 R 8.29 3.96 0.00 1.81 2.10 0.00 3.28 0.00 0.00 3.16 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.78 0.00 48 A 8.23 4.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.26 3.87 0.00 2.18 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.38 0.00 50 L 8.01 3.92 0.00 1.92 1.66 0.92 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 51 A 8.18 4.06 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 K 8.23 3.90 0.00 1.99 1.87 0.00 1.67 0.00 0.00 1.56 0.00 0.00 2.88 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.44 1.62 7.81 53 H 8.24 4.09 0.00 3.24 3.41 0.00 5.79 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 H 8.27 4.23 0.00 3.37 3.29 0.00 5.67 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 V 8.03 3.63 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 1.00 0.00 0.00 56 S 8.34 4.28 0.00 4.07 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 V 8.13 3.70 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.87 0.00 0.00 58 L 8.13 4.00 0.00 2.11 1.83 0.82 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 59 W 8.30 4.73 0.00 3.43 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 S 8.44 4.08 0.00 3.99 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 D 8.27 4.74 0.00 3.01 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 Y 7.51 3.38 0.00 1.43 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 F 7.85 4.18 0.00 3.29 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 K 7.93 4.66 0.00 1.40 1.47 0.00 1.61 0.00 0.00 1.71 0.00 0.00 2.81 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.29 1.15 7.81 65 P 0.00 4.42 0.00 2.15 2.18 0.00 3.55 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.29 0.00 66 P 0.00 4.19 0.00 1.96 2.02 0.00 3.37 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.09 0.00 67 H 8.02 4.39 0.00 2.84 3.15 0.00 5.63 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 F 7.56 4.45 0.00 3.13 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 E 8.30 4.04 0.00 1.98 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.31 0.00 70 K 7.97 4.05 0.00 1.68 1.66 0.00 1.63 0.00 0.00 1.59 0.00 0.00 2.86 0.00 0.00 2.75 0.00 0.00 0.00 0.00 0.30 1.01 7.81 71 Y 8.26 4.91 0.00 3.12 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 P 0.00 4.56 0.00 2.21 2.22 0.00 3.39 0.00 0.00 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.92 0.00 73 E 8.17 4.29 0.00 2.18 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.30 0.00 74 L 8.33 3.98 0.00 1.85 1.95 0.63 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 75 H 8.21 4.24 0.00 3.21 3.30 0.00 5.68 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 Q 8.05 3.88 0.00 2.14 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.91 0.00 0.00 0.00 0.00 0.00 2.41 2.57 0.00 77 L 7.89 3.87 0.00 1.89 1.85 1.10 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 78 V 7.74 3.39 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.00 0.00 1.02 0.00 0.00 79 N 7.76 3.96 0.00 2.57 2.70 0.00 0.00 7.27 7.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 D 8.22 4.08 0.00 2.42 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 T 7.56 3.46 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 82 L 7.82 3.94 0.00 1.67 1.62 0.78 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 83 K 8.02 3.89 0.00 1.80 1.78 0.00 1.63 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.38 1.45 7.81 84 A 8.06 4.04 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 M 8.21 4.04 0.00 2.25 2.07 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.79 0.00 86 S 8.30 4.09 0.00 4.05 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 A 7.96 4.03 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 A 8.10 4.18 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 K 8.07 3.93 0.00 1.95 2.03 0.00 1.69 0.00 0.00 1.94 0.00 0.00 3.20 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.63 7.81 90 G 7.66 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 S 7.21 4.74 0.00 3.82 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 K 8.51 4.23 0.00 1.79 1.84 0.00 1.80 0.00 0.00 1.63 0.00 0.00 2.81 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.39 1.41 7.81 93 D 8.29 4.57 0.00 2.67 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 P 0.00 5.02 0.00 2.20 2.10 0.00 3.94 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.03 0.00 95 A 8.55 4.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 T 8.27 3.97 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 97 G 8.18 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 Q 8.42 3.98 0.00 2.25 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.75 0.00 0.00 0.00 0.00 0.00 2.34 2.39 0.00 99 K 8.35 3.84 0.00 1.95 1.97 0.00 1.74 0.00 0.00 1.80 0.00 0.00 3.03 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.53 1.36 7.81 100 A 8.05 4.18 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 L 8.13 3.96 0.00 1.88 1.75 0.93 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 102 D 8.46 4.31 0.00 2.65 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 Y 7.96 4.19 0.00 3.25 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 I 8.22 3.78 2.02 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.71 0.93 0.00 0.00 105 A 8.39 4.22 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 Q 7.86 3.98 0.00 2.35 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.75 0.00 0.00 0.00 0.00 0.00 2.40 2.58 0.00 107 I 7.87 3.77 2.07 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.94 1.10 0.00 0.00 108 D 8.65 4.35 0.00 2.88 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 K 8.36 4.07 0.00 2.03 2.02 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.59 7.81 110 I 7.62 3.46 1.84 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.66 -0.07 0.00 0.00 111 F 8.84 3.94 0.00 3.01 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 W 8.27 4.24 0.00 3.44 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 E 8.43 4.26 0.00 2.31 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.65 0.00 114 T 7.70 4.53 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 115 K 7.44 4.13 0.00 2.03 2.01 0.00 1.67 0.00 0.00 1.56 0.00 0.00 2.23 0.00 0.00 2.81 0.00 0.00 0.00 0.00 0.76 0.92 7.81 116 K 7.85 4.49 0.00 1.90 1.89 0.00 1.83 0.00 0.00 1.82 0.00 0.00 3.12 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.62 1.63 7.81 117 A 7.71 4.16 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00